Name | Last modified | Size | Description | |
---|---|---|---|---|
Parent Directory | - | |||
start | 2019-03-21 21:25 | 33K | ||
sbatch.optim | 2019-03-22 07:43 | 430 | ||
redoxyz.sh | 2019-03-22 08:34 | 281 | ||
redopoints | 2019-03-21 21:25 | 430K | ||
perm.allow | 2019-03-21 21:25 | 1.2K | ||
path.vmd | 2019-03-22 14:20 | 21K | ||
path.info | 2019-03-21 21:25 | 596K | ||
output | 2019-03-22 16:35 | 13K | ||
odata.path | 2019-03-22 07:43 | 410 | ||
odata | 2019-03-22 16:35 | 667 | ||
min.rst | 2019-03-21 21:25 | 0 | ||
min.out | 2019-03-22 07:42 | 4.9K | ||
min.in | 2019-03-21 21:25 | 186 | ||
makepathfiles.sh | 2019-03-22 09:07 | 901 | ||
initial_cis_trans_states | 2019-03-22 07:42 | 1.1K | ||
initial_chiral_states | 2019-03-22 07:42 | 1.5K | ||
finish | 2019-03-22 09:10 | 33K | ||
energies | 2019-03-22 08:09 | 31 | ||
coords.prmtop | 2019-03-21 21:25 | 210K | ||
coords.mdcrd | 2019-03-22 16:35 | 11 | ||
coords.inpcrd | 2019-03-21 21:25 | 16K | ||
chirality_readable | 2019-03-22 07:41 | 2.6K | ||
EofS.6 | 2019-03-22 09:15 | 362K | ||
EofS.5 | 2019-03-22 09:15 | 305K | ||
EofS.4 | 2019-03-22 09:15 | 334K | ||
EofS.3 | 2019-03-22 09:15 | 300K | ||
EofS.2 | 2019-03-22 09:15 | 337K | ||
EofS.1 | 2019-03-22 09:15 | 195K | ||
EofS | 2019-03-22 16:35 | 1.5M | ||
6/ | 2019-03-26 08:10 | - | ||
5/ | 2019-03-26 08:10 | - | ||
4/ | 2019-03-26 08:10 | - | ||
3/ | 2019-03-26 08:10 | - | ||
2/ | 2019-03-26 08:10 | - | ||
1/ | 2019-03-26 08:10 | - | ||